3-methyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)butanamide
Chemical Structure Depiction of
3-methyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)butanamide
3-methyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)butanamide
Compound characteristics
| Compound ID: | V027-5410 |
| Compound Name: | 3-methyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)butanamide |
| Molecular Weight: | 449.6 |
| Molecular Formula: | C26 H35 N5 O2 |
| Salt: | not_available |
| Smiles: | CC(C)CC(N(CC=C)CC(N1CCCN(CC1)c1ccc(c2ccc(C)cc2)nn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9129 |
| logD: | 3.8797 |
| logSw: | -3.823 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.091 |
| InChI Key: | CRKILOSCWUEKEI-UHFFFAOYSA-N |